2-(5-nitro-6-pyridin-3-yloxy-pyrimidin-4-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indole

Systemtic Name: 2-(5-nitro-6-pyridin-3-yloxy-pyrimidin-4-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indole Openeye Name: 2-[5-nitro-6-(3-pyridyloxy)pyrimidin-4-yl]-1,3,4,9-tetrahydropyrido[3,4-b]indole CAS Name: 2-[5-nitro-6-(3-pyridinyloxy)-4-pyrimidinyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole IUPAC Name: 2-(5-nitro-6-pyridin-3-yloxypyrimidin-4-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indole Traditional Name: 2-[5-nitro-6-(3-pyridyloxy)pyrimidin-4-yl]-1,3,4,9-tetrahydro-$b-carboline Formula: C20H16N6O3 MolecularWeight: 388.37944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C3=CC=CC=C3N2)C4=C(C(=NC=N4)OC5=CN=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=C1C3=CC=CC=C3N2)C4=C(C(=NC=N4)OC5=CN=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C20H16N6O3/c27-26(28)18-19(22-12-23-20(18)29-13-4-3-8-21-10-13)25-9-7-15-14-5-1-2-6-16(14)24-17(15)11-25/h1-6,8,10,12,24H,7,9,11H2